N-[[4-(dimethylcarbamoyl)phenyl]methyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[[4-[dimethylamino(oxo)methyl]phenyl]methyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[[4-(dimethylcarbamoyl)phenyl]methyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[4-(dimethylcarbamoyl)benzyl]-3-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)N(C)C)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)N(C)C)NC1=S

InChI

InChI=1S/C21H22N4O3S/c1-4-25-20(28)16-10-9-15(11-17(16)23-21(25)29)18(26)22-12-13-5-7-14(8-6-13)19(27)24(2)3/h5-11H,4,12H2,1-3H3,(H,22,26)(H,23,29)